Information card for entry 7220404

Structure parameters

• Common name: 3
• Formula: C18 H34 Cr N7 O8
• Calculated formula: C18 H34 Cr N7 O8
• Title of publication: Interplay of ligand chirality and metal configuration in mononuclear complexes and in a coordination polymer of Cr(iii)
• Authors of publication: Wang, Ai; Merkens, Carina; Englert, Ulli
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 23
• Pages of publication: 4293
• a: 11.171 ± 0.004 Å
• b: 7.283 ± 0.002 Å
• c: 15.335 ± 0.005 Å
• α: 90°
• β: 101.113 ± 0.005°
• γ: 90°
• Cell volume: 1224.2 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1646
• Weighted residual factors for all reflections included in the refinement: 0.1697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No